318256-37-0
Product Name:
N-(TERT-BUTYL)-2-(3-THIENYLCARBONYL)-1,2,3,4-TETRAHYDRO-3-ISOQUINOLINECARBOXAMIDE
Formula:
C19H22N2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 342.5 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 342.14019912 g/mol |
| Monoisotopic Mass | 342.14019912 g/mol |
| Topological Polar Surface Area | 77.6 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 488 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |